SCHEMBL22551087

SCHEMBL22551087

O=C(OCC1CO1)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.44
LMNA P02545 2/20 0.42
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.37
TDP1 Q9NUW8 1/20 0.35
USP2 O75604 1/20 0.34
SLCO1B1 Q9Y6L6 1/20 0.34
MGLL Q99685 2/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28369176 1.00 PDE4A (0.44) PDE4ALMNAALDH1A1TP53CYP3A4
SCHEMBL8750994 0.82 ALDH1A1 (0.52) ALDH1A1TP53CYP3A4MGLL
Mannitol SCHEMBL28735254 0.78 LMNA (0.46) PDE4ALMNAALDH1A1TP53CYP3A4
Mannitol SCHEMBL26107249 0.78 LMNA (0.46) PDE4ALMNAALDH1A1TP53CYP3A4
SCHEMBL30425941 0.77 ALDH1A1 (0.47) ALDH1A1TP53CYP3A4MGLL
SCHEMBL27801804 0.76 PDE4A (0.47) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL3382998 0.76 PDE4A (0.47) PDE4ALMNAL3MBTL1TDP1USP2
Adonitol SCHEMBL20637061 0.74 TSHR (0.45) PDE4ALMNAALDH1A1TP53CYP3A4
Fructose SCHEMBL1177854 0.74 TSHR (0.38) PDE4ALMNAALDH1A1TP53CYP3A4
Fructose SCHEMBL22551085 0.74 TSHR (0.38) PDE4ALMNAALDH1A1TP53CYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3724143-A1 INSULATION PRODUCT COMPRISING MINERAL FIBERS AND A BINDER SAINT-GOBAIN ISOVER (FR) 2020-10-21 EP disclosed
CN-103787882-A Water-based acrylate and synthesis method thereof CHANGZHOU ADVANCED MAT INST OF BEIJING UNIV CHEMICAL TECH 2014-05-14 CN disclosed